In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 30 | No |
Popular Name: (5R)-4-(4-allyloxybenzoyl)-1-(2-dimethylaminoethyl)-3-hydroxy-5-(4-pyridyl)-5H-pyrrol-2-one (5R)-4-(4-allyloxybenzoyl)-1-(2-…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 1.82 | 9.05 | -73.74 | 1 | 7 | 0 | 87 | 407.47 | 9 | ↓ |
Hi High (pH 8-9.5) | 1.82 | 6.51 | -55.86 | 0 | 7 | -1 | 86 | 406.462 | 9 | ↓ |